%chk=000282518.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282518

0 1
O -2.761221 0.960921 -0.170168
O -4.055028 -0.862671 -0.695855
O -1.540621 -1.720366 1.248534
O 0.525341 2.306196 0.479547
O 4.130992 0.645367 -1.491257
N 1.062809 -1.936622 0.610398
N 2.373359 -1.898302 0.280313
N 1.799657 2.175863 -1.401772
N 5.067130 -0.781858 -0.000520
N 1.692172 3.566568 -1.664921
C -1.827732 -0.069177 -0.496890
C -2.702676 -1.312922 -0.834003
C -0.998638 -0.470812 0.747710
C -4.089772 0.396110 0.043198
C -2.361783 -2.362457 0.232635
C 0.446736 -0.697247 0.440078
C -5.077609 1.308621 -0.646895
C -4.321448 0.139730 1.516376
C 1.442159 0.177264 -0.029771
C 2.631230 -0.615306 -0.126154
C 1.234726 1.623753 -0.251118
C 3.973641 -0.194130 -0.613221
H -1.221016 0.345179 -1.324963
H -2.631786 -1.683685 -1.872953
H -1.122814 0.263246 1.585573
H -3.253702 -2.715623 0.782287
H -1.785824 -3.213096 -0.160304
H -5.115050 1.101373 -1.726968
H -6.093878 1.195559 -0.253495
H -4.777171 2.360765 -0.530470
H -4.329314 1.079048 2.084548
H -5.275221 -0.372927 1.688740
H -3.529275 -0.491239 1.948504
H 0.625902 -2.780761 0.969964
H 2.593168 1.733779 -1.912515
H 4.979717 -1.540288 0.657843
H 5.997580 -0.564881 -0.328269
H 0.706493 3.788480 -1.867950
H 1.927672 4.114746 -0.823819


%chk=000282518-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282518

0 1
O -3.036044 1.054856 0.002892
O -4.095674 -0.932406 -0.689377
O -1.550894 -1.505692 1.309802
O 0.127964 2.302658 -0.459906
O 4.459079 0.750792 -1.131004
N 1.036933 -1.625086 0.834180
N 2.372207 -1.716082 0.539075
N 2.304751 2.346363 -1.266476
N 4.918508 -1.341056 -0.241631
N 2.174343 3.726417 -1.582960
C -1.948978 0.160134 -0.413070
C -2.655022 -1.177990 -0.830799
C -1.014596 -0.216804 0.773820
C -4.295799 0.280580 0.155708
C -2.109091 -2.242682 0.141129
C 0.450976 -0.439238 0.437697
C -5.430633 1.098005 -0.455316
C -4.524865 -0.107640 1.624181
C 1.485557 0.324451 -0.159658
C 2.657687 -0.520411 -0.079388
C 1.259961 1.711447 -0.647630
C 4.064307 -0.307167 -0.526611
H -1.399193 0.678763 -1.208560
H -2.485306 -1.451767 -1.884821
H -1.116846 0.543154 1.565473
H -2.902359 -2.904758 0.519502
H -1.310645 -2.841786 -0.344479
H -5.195429 1.334715 -1.504956
H -6.374135 0.527290 -0.415596
H -5.560024 2.039833 0.104236
H -4.645985 0.804697 2.234037
H -5.441848 -0.716299 1.712580
H -3.669481 -0.683991 2.014853
H 0.549297 -2.360442 1.348743
H 3.258319 1.911165 -1.298125
H 4.563444 -2.165916 0.244718
H 5.896051 -1.265796 -0.516776
H 2.260182 3.880533 -2.597033
H 1.262186 4.045351 -1.216455


